6-chloranyl-1,1-bis(oxidanylidene)-3-(1-phenylethyl)-3,4-dihydro-2H-1$l^{6},2,4-benzothiadiazine-7-sulfonamide; 6-phenylpteridine-2,4,7-triamine

Systemtic Name: 6-chloranyl-1,1-bis(oxidanylidene)-3-(1-phenylethyl)-3,4-dihydro-2H-1$l^{6},2,4-benzothiadiazine-7-sulfonamide; 6-phenylpteridine-2,4,7-triamine Openeye Name: 6-chloro-1,1-dioxo-3-(1-phenylethyl)-3,4-dihydro-2H-1$l^{6},2,4-benzothiadiazine-7-sulfonamide; 6-phenylpteridine-2,4,7-triamine CAS Name: 6-chloro-1,1-dioxo-3-(1-phenylethyl)-3,4-dihydro-2H-1$l^{6},2,4-benzothiadiazine-7-sulfonamide; 6-phenylpteridine-2,4,7-triamine IUPAC Name: 6-chloro-1,1-dioxo-3-(1-phenylethyl)-3,4-dihydro-2H-1$l^{6},2,4-benzothiadiazine-7-sulfonamide; 6-phenylpteridine-2,4,7-triamine Traditional Name: 6-chloro-1,1-diketo-3-(1-phenylethyl)-3,4-dihydro-2H-1$l^{6},2,4-benzothiadiazine-7-sulfonamide; (2,4-diamino-6-phenyl-pteridin-7-yl)amine Formula: C27H27ClN10O4S2 MolecularWeight: 655.15088

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1NC2=CC(=C(C=C2S(=O)(=O)N1)S(=O)(=O)N)Cl)C3=CC=CC=C3.C1=CC=C(C=C1)C2=NC3=C(N=C2N)N=C(N=C3N)N

Isomeric SMILES

CC(C1NC2=CC(=C(C=C2S(=O)(=O)N1)S(=O)(=O)N)Cl)C3=CC=CC=C3.C1=CC=C(C=C1)C2=NC3=C(N=C2N)N=C(N=C3N)N

InChI

InChI=1S/C15H16ClN3O4S2.C12H11N7/c1-9(10-5-3-2-4-6-10)15-18-12-7-11(16)13(24(17,20)21)8-14(12)25(22,23)19-15;13-9-7(6-4-2-1-3-5-6)16-8-10(14)18-12(15)19-11(8)17-9/h2-9,15,18-19H,1H3,(H2,17,20,21);1-5H,(H6,13,14,15,17,18,19)